22-Methyltetracosanoic acid

Details

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Internal ID 21b42c8c-f8bf-45a0-86e2-eb3c06905438
Taxonomy Lipids and lipid-like molecules > Fatty Acyls > Fatty acids and conjugates > Very long-chain fatty acids
IUPAC Name 22-methyltetracosanoic acid
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C25H50O2/c1-3-24(2)22-20-18-16-14-12-10-8-6-4-5-7-9-11-13-15-17-19-21-23-25(26)27/h24H,3-23H2,1-2H3,(H,26,27)
InChI Key ROFGTBFWXLYRFY-UHFFFAOYSA-N
Popularity 3 references in papers

Physical and Chemical Properties

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Molecular Formula C25H50O2
Molecular Weight 382.70 g/mol
Exact Mass 382.381080833 g/mol
Topological Polar Surface Area (TPSA) 37.30 Ų
XlogP 11.70

Synonyms

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22-methyllignoceric acid
SCHEMBL1333784
CHEBI:84882
Q27158148

2D Structure

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2D Structure of 22-Methyltetracosanoic acid

3D Structure

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ADMET Properties (via admetSAR 2)

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Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

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Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 96.21% 96.09%
CHEMBL2581 P07339 Cathepsin D 95.69% 98.95%
CHEMBL3060 Q9Y345 Glycine transporter 2 93.17% 99.17%
CHEMBL5285 Q99683 Mitogen-activated protein kinase kinase kinase 5 92.21% 92.26%
CHEMBL1907591 P30926 Neuronal acetylcholine receptor; alpha4/beta4 87.86% 100.00%
CHEMBL3359 P21462 Formyl peptide receptor 1 87.52% 93.56%
CHEMBL3130 O00329 PI3-kinase p110-delta subunit 83.88% 96.47%
CHEMBL221 P23219 Cyclooxygenase-1 82.86% 90.17%
CHEMBL5845 P23415 Glycine receptor subunit alpha-1 82.52% 90.71%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 81.32% 97.29%
CHEMBL1781 P11387 DNA topoisomerase I 80.73% 97.00%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
To see more specific details click the taxa you are interested in.
There are no matching plants.

Cross-Links

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PubChem 15047965
LOTUS LTS0187309
wikiData Q27158148